RefChem:1078547
TL;DR: RefChem:1078547 (CAS 62064-76-0) is a chemical compound with molecular formula C11H15ClF3NO and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-[2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl]azanium chloride
Also Known As: alpha-Aminomethyl-N-ethyl-m-trifluoromethylbenzyl alcohol hydrochloride, Benzenemethanol, alpha-((ethylamino)methyl)-3-(trifluoromethyl)-, hydrochloride, ethyl-[2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl]azanium chloride, BENZYL ALCOHOL, alpha-AMINOMETHYL-N-ETHYL-m-TRIFLUOROMETHYL-, HYDROCHLORIDE, n-ethyl-2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethanaminiumchloride
| Molecular Formula | C11H15ClF3NO |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | -1.67 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.07944 |
| Heavy Atoms | 17 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 62064-76-0 |
|---|---|
| SMILES | CC[NH2+]CC(C1=CC(=CC=C1)C(F)(F)F)O.[Cl-] |
| InChIKey | AACPJCJVJLMRNG-UHFFFAOYSA-N |
Product Overview
RefChem:1078547 (CAS 62064-76-0), with molecular formula C11H15ClF3NO and molecular weight 269.08 g/mol. IUPAC: ethyl-[2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl]azanium chloride.
Chemical Property Profile of RefChem:1078547
Property Insights of RefChem:1078547
The XLogP value of -1.67 indicates that RefChem:1078547 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.8 Ų, RefChem:1078547 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1078547 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1078547?
The CAS number of RefChem:1078547 is 62064-76-0.
What is the molecular formula of RefChem:1078547?
The molecular formula of RefChem:1078547 is C11H15ClF3NO.
What is the molecular weight of RefChem:1078547?
The molecular weight of RefChem:1078547 is 269.08 g/mol.
Where can I buy RefChem:1078547?
You can request a quote for RefChem:1078547 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078547?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078547 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.